benzene-1,3,5-tricarboxylic acid; N-hexylhexan-1-amine

Systemtic Name: benzene-1,3,5-tricarboxylic acid; N-hexylhexan-1-amine Openeye Name: benzene-1,3,5-tricarboxylic acid; N-hexylhexan-1-amine CAS Name: benzene-1,3,5-tricarboxylic acid; N-hexyl-1-hexanamine IUPAC Name: benzene-1,3,5-tricarboxylic acid; N-hexylhexan-1-amine Traditional Name: dihexylamine; trimesic acid Formula: C33H60N2O6 MolecularWeight: 580.8393

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNCCCCCC.CCCCCCNCCCCCC.C1=C(C=C(C=C1C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCNCCCCCC.CCCCCCNCCCCCC.C1=C(C=C(C=C1C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/2C12H27N.C9H6O6/c2*1-3-5-7-9-11-13-12-10-8-6-4-2;10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h2*13H,3-12H2,1-2H3;1-3H,(H,10,11)(H,12,13)(H,14,15)